4-ethyl-2,3-dihydro-1H-pyrazole

C5H10N2 — CID 70232828

IUPAC4-ethyl-2,3-dihydro-1H-pyrazole
SMILESCCC1=CNNC1
InChIInChI=1S/C5H10N2/c1-2-5-3-6-7-4-5/h3,6-7H,2,4H2,1H3
InChIKeyUIGWKROOGZMMCM-UHFFFAOYSA-N
MW98.15 g/mol
LogP0.39
Rot. Bonds1

About 4-ethyl-2,3-dihydro-1H-pyrazole

4-ethyl-2,3-dihydro-1H-pyrazole (PubChem CID 70232828) has the molecular formula C5H10N2 and a molecular weight of 98.15 g/mol. Its IUPAC name is 4-ethyl-2,3-dihydro-1H-pyrazole.

Molecular Properties

Compound Name4-ethyl-2,3-dihydro-1H-pyrazole
PubChem CID70232828
Molecular FormulaC5H10N2
Molecular Weight98.15 g/mol
Exact Mass98.08
IUPAC Name4-ethyl-2,3-dihydro-1H-pyrazole
SMILESCCC1=CNNC1
InChIInChI=1S/C5H10N2/c1-2-5-3-6-7-4-5/h3,6-7H,2,4H2,1H3
InChIKeyUIGWKROOGZMMCM-UHFFFAOYSA-N
XLogP0.39
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50098.15
LogP ≤ 50.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2,3-dihydro-1H-pyrazole?
The IUPAC name of 4-ethyl-2,3-dihydro-1H-pyrazole (CID 70232828) is 4-ethyl-2,3-dihydro-1H-pyrazole.
What is the SMILES notation for 4-ethyl-2,3-dihydro-1H-pyrazole?
The canonical SMILES for 4-ethyl-2,3-dihydro-1H-pyrazole is CCC1=CNNC1.
What is the InChIKey of 4-ethyl-2,3-dihydro-1H-pyrazole?
The InChIKey is UIGWKROOGZMMCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2/c1-2-5-3-6-7-4-5/h3,6-7H,2,4H2,1H3.
What are the key properties of 4-ethyl-2,3-dihydro-1H-pyrazole?
4-ethyl-2,3-dihydro-1H-pyrazole has a molecular weight of 98.15 g/mol, XLogP of 0.39, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2,3-dihydro-1H-pyrazole is sourced from PubChem (CID 70232828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).